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CHEBI:229876 - benzoylcarnitine

ChEBI IDCHEBI:229876
ChEBI Namebenzoylcarnitine
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC14H19NO4
Net Charge0
Average Mass265.309
Monoisotopic Mass265.13141
SMILESC[N+](C)(C)C[C@@H](CC(=O)[O-])OC(=O)c1ccccc1
InChIInChI=1S/C14H19NO4/c1-15(2,3)10-12(9-13(16)17)19-14(18)11-7-5-4-6-8-11/h4-8,12H,9-10H2,1-3H3/t12-/m1/s1
InChIKeyAWUHAZDZHNWQAG-GFCCVEGCSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) feces (BTO:0000440) MetaboLights (MTBLS9087)
ChEBI Ontology
Outgoing Relation(s)
benzoylcarnitine (CHEBI:229876) is a benzoate ester (CHEBI:36054)
IUPAC Name 
(3R)-3-benzoyloxy-4-(trimethylazaniumyl)butanoate
Manual XrefsDatabases
HMDB0240664HMDB
114314ChemSpider